Geometry & MOs

Info

ID:

215135

PubChem CID:

85084207

Reduced:

O7N8C36H54 (1)

Stoich.:

A7B8C36D54 (1)

Weight, g/mol:

710.533693

ΔHf, kcal/mol:

-304.21

Dipole, Da:

5.06

IP(EA), eV:

 -9.26(0.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl-[[3-[4-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(1-ethoxyethoxy)-3-methylcyclohexylidene]butylidene]-2-(1-ethoxyethoxy)-1-methylcyclohexyl]methoxy]-dimethylsilane

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(CCOC)C(=O)N)NC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCCN)N

DOS

IR

Vibrations